Highly efficient path-integral molecular dynamics simulations with GPUMD using neuroevolution potentials: Case studies on thermal properties of materials

Fuente: arXiv

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Bibliographic Details
Main Authors:	Ying, Penghua, Zhou, Wenjiang, Svensson, Lucas, Berger, Esmée, Fransson, Erik, Eriksson, Fredrik, Xu, Ke, Liang, Ting, Xu, Jianbin, Song, Bai, Chen, Shunda, Erhart, Paul, Fan, Zheyong
Format:	Preprint
Published:	2024
Subjects:	Materials Science Statistical Mechanics
Online Access:	Acceder al recurso
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Internet

https://arxiv.org/abs/2409.04430